Predictive potential of eigenvalues-based graphical indices for determining thermodynamic properties of polycyclic aromatic hydrocarbons with applications to polyacenes
Sakander Hayat, Hilalina Mahadi, Seham J. F. Alanazi, Shaohui Wang
Topics & Concepts
Eigenvalues and eigenvectorsGraphical displayChemistryComputational chemistryComputer sciencePhysicsQuantum mechanicsComputer graphics (images)Graph theory and applicationsComputational Drug Discovery MethodsFree Radicals and Antioxidants